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SMILES: O=C(OCCc1ccccc1)c1cccc(=O)[nH]1

InChI Key: InChIKey=HLKJVILSXJCTNG-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50227541   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Macrophage metalloelastase


(Homo sapiens (Human))
BDBM50227541
PNG
(CHEMBL255051 | phenethyl 6-oxo-1,6-dihydropyridine...)
Show SMILES O=C(OCCc1ccccc1)c1cccc(=O)[nH]1
Show InChI InChI=1S/C14H13NO3/c16-13-8-4-7-12(15-13)14(17)18-10-9-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,15,16)
PDB
MMDB

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n/an/a 6.80E+4n/an/an/an/an/an/a



North Dakota State University

Curated by ChEMBL


Assay Description
Inhibition of MMP12


Bioorg Med Chem Lett 17: 6864-70 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.020
BindingDB Entry DOI: 10.7270/Q2C24X80
More data for this
Ligand-Target Pair
Matrix metalloproteinase-9


(Homo sapiens (Human))
BDBM50227541
PNG
(CHEMBL255051 | phenethyl 6-oxo-1,6-dihydropyridine...)
Show SMILES O=C(OCCc1ccccc1)c1cccc(=O)[nH]1
Show InChI InChI=1S/C14H13NO3/c16-13-8-4-7-12(15-13)14(17)18-10-9-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,15,16)
PDB
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n/an/a 8.10E+4n/an/an/an/an/an/a



North Dakota State University

Curated by ChEMBL


Assay Description
Inhibition of MMP9


Bioorg Med Chem Lett 17: 6864-70 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.020
BindingDB Entry DOI: 10.7270/Q2C24X80
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50227541
PNG
(CHEMBL255051 | phenethyl 6-oxo-1,6-dihydropyridine...)
Show SMILES O=C(OCCc1ccccc1)c1cccc(=O)[nH]1
Show InChI InChI=1S/C14H13NO3/c16-13-8-4-7-12(15-13)14(17)18-10-9-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,15,16)
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n/an/a 6.90E+4n/an/an/an/an/an/a



North Dakota State University

Curated by ChEMBL


Assay Description
Inhibition of MMP2


Bioorg Med Chem Lett 17: 6864-70 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.020
BindingDB Entry DOI: 10.7270/Q2C24X80
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))
BDBM50227541
PNG
(CHEMBL255051 | phenethyl 6-oxo-1,6-dihydropyridine...)
Show SMILES O=C(OCCc1ccccc1)c1cccc(=O)[nH]1
Show InChI InChI=1S/C14H13NO3/c16-13-8-4-7-12(15-13)14(17)18-10-9-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,15,16)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
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antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.70E+4n/an/an/an/an/an/a



North Dakota State University

Curated by ChEMBL


Assay Description
Inhibition of MMP1


Bioorg Med Chem Lett 17: 6864-70 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.020
BindingDB Entry DOI: 10.7270/Q2C24X80
More data for this
Ligand-Target Pair